1-naphthalen-2-yl-3-[2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]urea

Systemtic Name: 1-naphthalen-2-yl-3-[2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]urea Openeye Name: 1-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-3-(2-naphthyl)urea CAS Name: 1-(2-naphthalenyl)-3-[2-[4-(phenylmethyl)-1-piperazin-1-iumyl]ethyl]urea IUPAC Name: 1-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-3-naphthalen-2-ylurea Traditional Name: 1-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-3-(2-naphthyl)urea Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)NC2=CC3=CC=CC=C3C=C2)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)NC2=CC3=CC=CC=C3C=C2)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O/c29-24(26-23-11-10-21-8-4-5-9-22(21)18-23)25-12-13-27-14-16-28(17-15-27)19-20-6-2-1-3-7-20/h1-11,18H,12-17,19H2,(H2,25,26,29)/p+1